| SpectraBase Spectrum ID |
AvvzGParbaD |
| Name |
4,4'-((3aR,6aR)-3,3a,6,6a-Tetrahydropentalene-1,4-diyl)diphenol |
| Appearance |
Red-brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.130679818 u |
| Formula |
C20H18O2 |
| InChI |
InChI=1S/C20H18O2/c21-15-5-1-13(2-6-15)17-9-11-20-18(10-12-19(17)20)14-3-7-16(22)8-4-14/h1-10,19-22H,11-12H2/t19-,20-/m0/s1 |
| InChIKey |
AGYRZIKJIADZPC-PMACEKPBSA-N |
| Instrument Name |
Varian MAT 711 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201900947 |
| Molecular Weight |
290.362 g/mol |
| Optical Rotation |
[a]D20 = -29.5 (c = 5.67 mg/mL, DMSO) |
| Quality |
265 |
| Reported Formula |
C20H18O2 |
| SMILES |
OC1=CC=C(C2=CC[C@@]3([C@]2(CC=C3C2=CC=C(C=C2)O)[H])[H])C=C1 |
| SPLASH |
splash10-0006-0390000000-1765e17112b9ba71f30b |
| Source of Spectrum |
QE-25-SM20-4e (DOI: 10.1002/chem.201900947) |
| Thin-Layer Chromatography |
0.53 (hexanes/EtOAc, 2:1, KMnO4) |
| Wiley ID |
1893813 |
